Vitas-M small molecule compound
3-(4-butoxyphenyl)-11-phenyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK741911
SMILES CCCCOc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccccc1)C(=O)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H29F3N2O3 MW 534.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29F3N2O3/c1-2-3-17-39-23-15-13-20(14-16-23)22-18-25-28(27(37)19-22)29(21-9-5-4-6-10-21)36(30(38)31(32,33)34)26-12-8-7-11-24(26)35-25/h4-16,22,29,35H,2-3,17-19H2,1H3InChIKey
NXXUVXLZWLKZGY-UHFFFAOYSA-NSynonyms
354539-43-83(4butoxyphenyl)11phenyl10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4butoxyphenyl)11phenyl10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
354539438
9(4butoxyphenyl)6phenyl5(222trifluoroacetyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C(F)(F)F)C5=CC=CC=C5)C(=O)C2
InChI=1SC31H29F3N2O3c123173923151320(141623)22182528(27(37)1922)29(2195461021)36(30(38)31(3233)34)2612871124(26)3525h416222935H231719H21H3
MFCD01947111
ZINC000008445122
ZINC000008445125
ZINC08445122
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